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Home > Aldehydes > 1935349-49-7
1935349-49-7 | 2-bromo-6-(3-hydroxyazetidin-1-yl)benzaldehyde
CAS No: 1935349-49-7 Catalog No: AG01C8XS MDL No:MFCD31443386
Product Description
Catalog Number:
AG01C8XS
Chemical Name:
2-bromo-6-(3-hydroxyazetidin-1-yl)benzaldehyde
CAS Number:
1935349-49-7
Molecular Formula:
C10H10BrNO2
Molecular Weight:
256.0959
MDL Number:
MFCD31443386
IUPAC Name:
2-bromo-6-(3-hydroxyazetidin-1-yl)benzaldehyde
InChI:
InChI=1S/C10H10BrNO2/c11-9-2-1-3-10(8(9)6-13)12-4-7(14)5-12/h1-3,6-7,14H,4-5H2
InChI Key:
XUDNIWTZBVJFNE-UHFFFAOYSA-N
SMILES:
O=Cc1c(Br)cccc1N1CC(C1)O
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.989g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.099g/mol
Monoisotopic Mass:
254.989g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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